1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one

C22H24N4O2 — CID 175645173

About 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one

1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one (PubChem CID 175645173) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one.

Molecular Properties

• Compound Name: 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one
• PubChem CID: 175645173
• Molecular Formula: C22H24N4O2
• Molecular Weight: 376.46 g/mol
• Exact Mass: 376.19
• IUPAC Name: 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one
• SMILES: Cc1ccn(C2CC2)c(=O)c1C(=O)N1CCCC1c1nc2c(C)cccc2[nH]1
• InChI: InChI=1S/C22H24N4O2/c1-13-10-12-25(15-8-9-15)21(27)18(13)22(28)26-11-4-7-17(26)20-23-16-6-3-5-14(2)19(16)24-20/h3,5-6,10,12,15,17H,4,7-9,11H2,1-2H3,(H,23,24)
• InChIKey: UMUNJZYKTZCVFT-UHFFFAOYSA-N
• XLogP: 3.65
• TPSA: 70.99 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 3
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	376.46
LogP ≤ 5	3.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one?

The IUPAC name of 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one (CID 175645173) is 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one.

What is the SMILES notation for 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one?

The canonical SMILES for 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one is Cc1ccn(C2CC2)c(=O)c1C(=O)N1CCCC1c1nc2c(C)cccc2[nH]1.

What is the InChIKey of 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one?

The InChIKey is UMUNJZYKTZCVFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-13-10-12-25(15-8-9-15)21(27)18(13)22(28)26-11-4-7-17(26)20-23-16-6-3-5-14(2)19(16)24-20/h3,5-6,10,12,15,17H,4,7-9,11H2,1-2H3,(H,23,24).

What are the key properties of 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one?

1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one has a molecular weight of 376.46 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one is sourced from PubChem (CID 175645173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).